In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 25th, 2004 | 34 | Yes |
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 1.19 | -3.63 | -23.6 | 2 | 9 | 0 | 113 | 479.562 | 10 | ↓ |
Lo Low (pH 4.5-6) | 1.75 | -3.52 | -57.67 | 3 | 9 | 1 | 118 | 480.57 | 9 | ↓ |